0 mol 27 unq 0 iso 0 dist 9.61335 15.1609 5.80623 12.6609 7.96312 9.19908 numMergedOcc 0
1 mol 27 unq 1 iso 0 dist 9.61335 15.1609 5.80623 8.34493 7.67129 11.8741 numMergedOcc 0
2 mol 27 unq 2 iso 0 dist 9.61335 10.5197 7.24775 12.6609 7.96312 14.4555 numMergedOcc 0
3 mol 27 unq 3 iso 0 dist 9.61335 10.5197 7.24775 8.34493 7.67129 12.0486 numMergedOcc 0
4 mol 75 unq 0 iso 0 dist 8.73268 5.36918 8.52499 6.17656 9.10622 8.15146 numMergedOcc 0
5 mol 75 unq 1 iso 0 dist 8.73268 7.84419 6.2449 6.17656 9.10622 5.49106 numMergedOcc 0
6 mol 92 unq 0 iso 0 dist 9.14582 6.05632 8.57012 7.88521 8.96747 10.7488 numMergedOcc 0
7 mol 100 unq 0 iso 0 dist 5.38064 5.68555 8.79499 4.21773 6.56978 7.98273 numMergedOcc 0
8 mol 103 unq 0 iso 0 dist 6.37224 5.75619 6.87901 6.89318 9.6403 6.38018 numMergedOcc 0
9 mol 115 unq 0 iso 0 dist 6.75179 10.7909 8.12514 7.32598 7.81731 9.28059 numMergedOcc 0
10 mol 120 unq 0 iso 0 dist 9.52973 10.5223 8.41086 14.2657 8.64019 5.39993 numMergedOcc 0
11 mol 120 unq 1 iso 0 dist 9.52973 4.18642 7.41599 14.2657 8.64019 12.6549 numMergedOcc 0
12 mol 123 unq 0 iso 0 dist 8.29394 10.1127 9.89206 7.04318 9.52442 8.94071 numMergedOcc 0
13 mol 123 unq 1 iso 0 dist 5.98534 6.76538 9.89206 5.76997 9.52442 8.94071 numMergedOcc 0
14 mol 272 unq 0 iso 0 dist 9.86987 11.5946 5.9131 18.6263 8.86801 9.49668 numMergedOcc 0
15 mol 272 unq 1 iso 0 dist 9.86987 11.5946 5.9131 15.2564 7.15093 4.36153 numMergedOcc 0
16 mol 272 unq 2 iso 0 dist 9.86987 12.9792 8.16917 18.6263 8.86801 13.1454 numMergedOcc 0
17 mol 272 unq 3 iso 0 dist 9.86987 12.9792 8.16917 15.2564 7.15093 13.7982 numMergedOcc 0
18 mol 272 unq 4 iso 0 dist 9.88921 6.36261 5.9131 11.9608 8.86801 9.49668 numMergedOcc 0
19 mol 272 unq 5 iso 0 dist 9.88921 6.36261 5.9131 8.8375 7.15093 4.36153 numMergedOcc 0
20 mol 272 unq 6 iso 0 dist 9.88921 17.9408 8.16917 11.9608 8.86801 13.1454 numMergedOcc 0
21 mol 272 unq 7 iso 0 dist 9.88921 17.9408 8.16917 8.8375 7.15093 13.7982 numMergedOcc 0
22 mol 278 unq 0 iso 0 dist 8.31165 5.51026 5.79682 9.05496 8.30195 5.10052 numMergedOcc 0
